TL;DR: 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid (CAS 107027-44-1) is a chemical compound with molecular formula C17H12BrNO2 and molecular weight 341.00513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-bromophenyl)-8-methylquinoline-4-carboxylic acid
Also Known As: 2-(4-bromophenyl)-8-methylquinoline-4-carboxylic acid, 8360AC, 2-(4-bromophenyl)-8-methyl-4-quinolinecarboxylic acid, 2-(4-BROMOPHENYL)-8-METHYLQUINOLINE-4-CARBOXYLICACID, 2-phenyl-8-methylquinoline-4-carboxylic acid
| Molecular Formula | C17H12BrNO2 |
| Molecular Weight | 341.00513 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.00513 Da |
| Heavy Atoms | 21 |
| Complexity | 381.0 |
| SMILES | CC1=C2C(=CC=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)O |
| InChIKey | AXOVQGHAUJNNRK-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid is 107027-44-1.
The molecular formula of 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid is C17H12BrNO2.
The molecular weight of 2-(4-Bromophenyl)-8-methyl-4-quinolinecarboxylic acid is 341.00513 g/mol.
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